Vitas-M small molecule compound

N-(2-methylpropyl)-5-(morpholin-4-yl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-amine

Catalog ID
STK524503
SMILES CC(CNc1ncnc2c1sc1c2c2CCCCc2c(n1)N1CCOCC1)C

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C21H27N5OS MW 397.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H27N5OS/c1-13(2)11-22-19-18-17(23-12-24-19)16-14-5-3-4-6-15(14)20(25-21(16)28-18)26-7-9-27-10-8-26/h12-13H,3-11H2,1-2H3,(H,22,23,24)
InChIKey
SCANDCOJXCVMCE-UHFFFAOYSA-N
Synonyms

CC(C)CNC1=NC=NC2=C1SC3=NC(=C4CCCCC4=C23)N5CCOCC5
InChI=1SC21H27N5OSc113(2)1122191817(23122419)1614534615(14)20(2521(16)2818)26792710826h1213H311H212H3(H222324)
MFCD01959991
N(2methylpropyl)5(morpholin4yl)1234tetrahydropyrimido(4545)thieno(23c)isoquinolin8amine
Nisobutyl5morpholino1234tetrahydropyrimido(4545)thieno(23c)isoquinolin8amine
ZINC000019708562
ZINC19708562

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.